SCHEMBL1623633

SCHEMBL1623633

CC(C)(C)c1ccc(-c2cccs2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.52
KCNH2 Q12809 1/20 0.50
KIF11 P52732 2/20 0.47
LPL P06858 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
CYP17A1 P05093 1/20 0.46
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
HDAC1 Q13547 4/20 0.43
HDAC2 Q92769 4/20 0.43
CYP2E1 P05181 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2A6 P11509 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2B6 P20813 1/20 0.42
ERN1 O75460 1/20 0.42
HDAC3 O15379 3/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Methane SCHEMBL27303630 0.98 LTA4H (0.50) LTA4HKCNH2KIF11LPLLIPG
SCHEMBL27961808 0.91 PRMT6 (0.47) LTA4HKCNH2KIF11LPLLIPG
SCHEMBL21391895 0.89 LTA4H (0.43) LTA4HKCNH2KIF11LPLLIPG
SCHEMBL10472472 0.87 DPP4 (0.49) LTA4HKCNH2KIF11LPLLIPG
SCHEMBL16546585 0.84 LTA4H (0.48) LTA4HKCNH2LPLLIPGPRMT6
SCHEMBL9257921 0.84 KIF11 (0.55) LTA4HKCNH2KIF11LPLLIPG
SCHEMBL21931869 0.84 TSHR (0.44) LTA4HKCNH2KIF11LPLLIPG
SCHEMBL27961856 0.83 LTA4H (0.42) LTA4HKCNH2KIF11HDAC1HDAC2
SCHEMBL338810 0.82 LTA4H (0.70) LTA4HKCNH2LPLLIPGPRMT6
SCHEMBL20595524 0.82 KCNH2 (0.48) LTA4HKCNH2KIF11PRMT6HDAC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 88 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113122241-A Quantum dot material and preparation method thereof, quantum dot light-emitting diode and light-emitting device TCL集团股份有限公司 2021-07-16 CN claimed
US-20230271969-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-31 US disclosed
US-20230271969-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-31 US disclosed
CN-108690045-B Diarylethene compounds and uses thereof 首诺加拿大公司 2022-08-30 CN disclosed
CN-111450123-B Use of hathwayi or taurine for preparing medicine for preventing and treating intracranial aneurysm formation and rupture 中国医学科学院阜外医院 2021-11-02 CN disclosed
US-10763449-B2 Organic light-emitting diode (OLED) display panel, fabrication method and electronic device thereof Shanghai Tianma AM-OLED Co., Ltd. (CN) 2020-09-01 US disclosed
CN-111373077-A Sn or Sn alloy plating solution and method for producing Sn or Sn alloy plating 上村工业株式会社 2020-07-03 CN disclosed
EP-3613504-A1 PI-ALLYLPALLADIUM AND PI-ALLYLNICKEL COMPLEXES FOR USE AS CATALYSTS IN CARBON-CARBON AND CARBON-NITROGEN COUPLING REACTIONS Johnson Matthey Public Limited Company (GB) 2020-02-26 EP disclosed
EP-2585216-B1 PI-ALLYLPALLADIUM AND PI-ALLYLNICKEL COMPLEXES FOR USE AS CATALYSTS IN CARBON-CARBON AND CARBON-NITROGEN COUPLING REACTIONS JOHNSON MATTHEY PLC (GB) 2019-11-20 EP disclosed
US-10202354-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-12 US disclosed
EP-0155345-A2 Pleochroic anthraquinone dyes The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1985-09-25 EP disclosed
EP-0142617-A1 Pleochroic anthraquinone dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-05-29 EP disclosed
US-4496221-A FREE FROM WATER SOLUBILIZERS AND IONIC SUBSTIVENTS;CONTRAST Secretary of State for Defence in Her Britanic Majesty's Government of the United Kingdom of Great Britain and Northern Ireland of Whitehall (GB) 1985-01-29 US disclosed
US-4464282-A ANTHRAQUINONE PLEOCHROIC DYE FOR LIQUID CRYSTALS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITIAN AND NORTHERN IRELAND (GB) 1984-08-07 US disclosed
US-4455253-A FOR LIQUID CRYSTAL DISPLAYS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-06-19 US disclosed
EP-0108472-A2 Organic materials for a liquid crystal device The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1984-05-16 EP disclosed
US-4446047-A Pleochroic anthraquinone dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-05-01 US disclosed
EP-0103952-A2 Pleochroic anthraquinone dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-03-28 EP disclosed
EP-0059036-A1 Pleochroic anthraquinone dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-09-01 EP disclosed
EP-0059095-A1 Liquid crystal materials comprising pleochroic dyes The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1982-09-01 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230271969-A1 NITROGEN-CONTAINING FUSED RING DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF NR5A1, WEE1, SHBG LTA4H 1289/4885KCNH2 797/4885KIF11 628/4885
US-10202354-B2 Therapeutic compounds and uses thereof KDM1B, KDM6B, KDM2B LTA4H 2865/4885KCNH2 2469/4885KIF11 2129/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.